2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide

C9H10F2N2O2 — CID 118809416

IUPAC2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide
SMILESCOc1cnc(C(F)F)c(C(N)=O)c1C
InChIInChI=1S/C9H10F2N2O2/c1-4-5(15-2)3-13-7(8(10)11)6(4)9(12)14/h3,8H,1-2H3,(H2,12,14)
InChIKeyUCYCBWSFSSEKOM-UHFFFAOYSA-N
MW216.19 g/mol
LogP1.44
Rot. Bonds3

About 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide

2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide (PubChem CID 118809416) has the molecular formula C9H10F2N2O2 and a molecular weight of 216.19 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide
PubChem CID118809416
Molecular FormulaC9H10F2N2O2
Molecular Weight216.19 g/mol
Exact Mass216.07
IUPAC Name2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide
SMILESCOc1cnc(C(F)F)c(C(N)=O)c1C
InChIInChI=1S/C9H10F2N2O2/c1-4-5(15-2)3-13-7(8(10)11)6(4)9(12)14/h3,8H,1-2H3,(H2,12,14)
InChIKeyUCYCBWSFSSEKOM-UHFFFAOYSA-N
XLogP1.44
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.19
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide?
The IUPAC name of 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide (CID 118809416) is 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide?
The canonical SMILES for 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide is COc1cnc(C(F)F)c(C(N)=O)c1C.
What is the InChIKey of 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide?
The InChIKey is UCYCBWSFSSEKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O2/c1-4-5(15-2)3-13-7(8(10)11)6(4)9(12)14/h3,8H,1-2H3,(H2,12,14).
What are the key properties of 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide?
2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide has a molecular weight of 216.19 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide is sourced from PubChem (CID 118809416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).